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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:59 UTC
Update Date2025-03-21 18:36:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00112723
Frequency23.5
Structure
Chemical FormulaC20H23NO2
Molecular Mass309.1729
SMILESCC(C)NCC(O)COc1ccc2c(ccc3ccccc32)c1
InChI KeyAJCBGEQHJSLGJN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenanthrenes and derivatives
Subclass phenanthrenes and derivatives
Direct Parent phenanthrenes and derivatives
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • dialkylamines
  • hydrocarbon derivatives
  • naphthalenes
  • organopnictogen compounds
  • phenol ethers
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • secondary aliphatic amine
  • phenanthrene
  • ether
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • secondary amine
  • naphthalene
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine